[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(3-ethylphenyl)azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(3-ethylphenyl)azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-(3-ethylphenyl)ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-(3-ethylphenyl)ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-(3-ethylphenyl)azanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-(3-ethylphenyl)ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)[NH2+]CC(=O)N2CCCCCC2

Isomeric SMILES

CCC1=CC(=CC=C1)[NH2+]CC(=O)N2CCCCCC2

InChI

InChI=1S/C16H24N2O/c1-2-14-8-7-9-15(12-14)17-13-16(19)18-10-5-3-4-6-11-18/h7-9,12,17H,2-6,10-11,13H2,1H3/p+1